(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one

C7H14N2O — CID 163460023

IUPAC(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one
SMILESCC[C@@H]1CCC(=O)N1NC
InChIInChI=1S/C7H14N2O/c1-3-6-4-5-7(10)9(6)8-2/h6,8H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyBNUATHWTBYGKEU-ZCFIWIBFSA-N
MW142.20 g/mol
LogP0.52
Rot. Bonds2

About (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one

(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one (PubChem CID 163460023) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one.

Molecular Properties

Compound Name(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one
PubChem CID163460023
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one
SMILESCC[C@@H]1CCC(=O)N1NC
InChIInChI=1S/C7H14N2O/c1-3-6-4-5-7(10)9(6)8-2/h6,8H,3-5H2,1-2H3/t6-/m1/s1
InChIKeyBNUATHWTBYGKEU-ZCFIWIBFSA-N
XLogP0.52
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 50.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one?
The IUPAC name of (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one (CID 163460023) is (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one.
What is the SMILES notation for (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one?
The canonical SMILES for (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one is CC[C@@H]1CCC(=O)N1NC.
What is the InChIKey of (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one?
The InChIKey is BNUATHWTBYGKEU-ZCFIWIBFSA-N. The full InChI is InChI=1S/C7H14N2O/c1-3-6-4-5-7(10)9(6)8-2/h6,8H,3-5H2,1-2H3/t6-/m1/s1.
What are the key properties of (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one?
(5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one has a molecular weight of 142.20 g/mol, XLogP of 0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-ethyl-1-(methylamino)pyrrolidin-2-one is sourced from PubChem (CID 163460023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).